N-[(2S,11Br)-1,3,4,6,7,11B-Hexahydro-2H-Pyrido[2,1-A]Isoquinolin-2-Yl]-N-Methylmethanesulfonamide

Molecule SVG Image

Properties Simple | Detailed

Formula C15H22N2O2S
IUPAC Name n-[(2s,5s,11br)-2,3,4,6,7,11b-hexahydro-1h-benzo[a]quinolizin-2-yl]-n-methyl-methanesulfonamide
Molecular Mass 294.412 g·mol−1
Heat of Formation -271.4 ± 16.7 kJ·mol−1
Dipole Moment 3.52 ± 1.08 D
Volume 348.83 Å 3
Surface Area 301.39 Å 2
HOMO Energy -8.83 ± 0.55 eV
LUMO Energy 0.24 ± eV
Point Group Symmetry C1
Synonyms
  • methanesulfonamide, n-(1,3,4,6,7,11b-hexahydro-2h-benzo(a)quinolizin-2-yl)-n-methyl-, trans-
  • n-[(2s,11br)-2,3,4,6,7,11b-hexahydro-1h-pyrido[2,1-a]isoquinolin-2-yl]-n-methyl-methanesulfonamide
  • n-[(2s,11br)-2,3,4,6,7,11b-hexahydro-1h-pyrido[2,1-a]isoquinolin-2-yl]-n-methylmethanesulfonamide
  • wy 25309
  • wy-25309
CAS Number(s)
  • 82059-40-3
InChIKey KJTKDAHVWBKJDZ-DZGCQCFKSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N